## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
B |
108 |
28 |
17224 |
◊ |
A |
x,y,z |
1_555 |
106 |
25 |
17877 |
923.2 |
-16.7 |
0.017 |
6 |
0 |
0 |
1.000 |
2 |
|
[ACX]B:1325 |
45 |
1 |
963 |
f |
B |
x,y,z |
1_555 |
76 |
20 |
17224 |
476.1 |
-3.9 |
0.713 |
4 |
0 |
0 |
0.464 |
3 |
|
[ACX]A:1325 |
45 |
1 |
958 |
f |
A |
x,y,z |
1_555 |
75 |
20 |
17877 |
471.0 |
-5.5 |
0.568 |
7 |
0 |
0 |
0.698 |
4 |
|
[ACX]A:1326 |
37 |
1 |
1007 |
f |
A |
x,y,z |
1_555 |
68 |
25 |
17877 |
452.9 |
-4.3 |
0.615 |
7 |
0 |
0 |
0.602 |
5 |
|
[ACX]B:1326 |
39 |
1 |
969 |
f |
B |
x,y,z |
1_555 |
64 |
24 |
17224 |
431.4 |
-3.5 |
0.717 |
9 |
0 |
0 |
0.606 |
6 |
|
[C8E]B:1337 |
19 |
1 |
676 |
f |
B |
x,y,z |
1_555 |
67 |
19 |
17224 |
370.7 |
0.8 |
0.241 |
1 |
0 |
0 |
0.000 |
7 |
|
[C8E]A:1330 |
16 |
1 |
556 |
f |
A |
x,y,z |
1_555 |
54 |
16 |
17877 |
305.9 |
0.6 |
0.270 |
0 |
0 |
0 |
0.000 |
8 |
|
B |
27 |
8 |
17224 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
25 |
8 |
17877 |
248.7 |
-1.2 |
0.545 |
4 |
0 |
0 |
0.000 |
9 |
|
B |
31 |
10 |
17224 |
◊ |
A |
-x+2,-y,z |
2_755 |
31 |
9 |
17877 |
246.4 |
-3.3 |
0.182 |
4 |
2 |
0 |
0.000 |
10 |
|
[C8E]A:1329 |
17 |
1 |
581 |
f |
A |
x,y,z |
1_555 |
31 |
9 |
17877 |
241.4 |
-2.4 |
0.130 |
0 |
0 |
0 |
0.197 |
11 |
|
[C8E]A:1328 |
19 |
1 |
556 |
f |
A |
x,y,z |
1_555 |
42 |
14 |
17877 |
223.8 |
-0.2 |
0.278 |
0 |
0 |
0 |
0.015 |
12 |
|
[C8E]A:1337 |
18 |
1 |
632 |
◊ |
B |
-x+2,-y+1,z |
2_765 |
23 |
10 |
17224 |
218.6 |
-0.2 |
0.111 |
0 |
0 |
0 |
0.000 |
13 |
|
[C8E]A:1337 |
18 |
1 |
632 |
f |
A |
x,y,z |
1_555 |
26 |
9 |
17877 |
214.1 |
-0.5 |
0.122 |
0 |
0 |
0 |
0.039 |
14 |
|
B |
28 |
8 |
17224 |
◊ |
A |
-x+2,-y+1,z |
2_765 |
27 |
8 |
17877 |
211.2 |
-2.7 |
0.330 |
2 |
0 |
0 |
0.000 |
15 |
|
[C8E]B:1328 |
16 |
1 |
505 |
◊ |
B |
x,y,z |
1_555 |
35 |
12 |
17224 |
210.4 |
4.6 |
0.443 |
0 |
0 |
0 |
0.000 |
16 |
|
[C8E]B:1331 |
14 |
1 |
472 |
f |
B |
x,y,z |
1_555 |
38 |
12 |
17224 |
202.5 |
0.6 |
0.114 |
0 |
0 |
0 |
0.000 |
17 |
|
[C8E]B:1343 |
13 |
1 |
422 |
f |
B |
x,y,z |
1_555 |
31 |
10 |
17224 |
193.7 |
2.1 |
0.166 |
0 |
0 |
0 |
0.000 |
18 |
|
[C8E]B:1327 |
20 |
1 |
634 |
f |
B |
x,y,z |
1_555 |
33 |
13 |
17224 |
187.9 |
-2.1 |
0.168 |
0 |
0 |
0 |
0.169 |
19 |
|
[C8E]A:1338 |
13 |
1 |
424 |
f |
B |
-x+2,-y+1,z |
2_765 |
29 |
9 |
17224 |
183.8 |
-2.9 |
0.205 |
0 |
0 |
0 |
0.237 |
20 |
|
[C8E]A:1332 |
10 |
1 |
390 |
f |
A |
x,y,z |
1_555 |
28 |
9 |
17877 |
179.1 |
0.3 |
0.271 |
0 |
0 |
0 |
0.000 |
21 |
|
[C8E]A:1331 |
14 |
1 |
422 |
f |
A |
x,y,z |
1_555 |
33 |
8 |
17877 |
176.6 |
-0.5 |
0.481 |
3 |
0 |
0 |
0.145 |
22 |
|
[C8E]A:1339 |
9 |
1 |
335 |
f |
[ACX]A:1326 |
x,y,z |
1_555 |
32 |
1 |
1007 |
176.3 |
5.9 |
0.052 |
0 |
0 |
0 |
0.000 |
23 |
|
[C8E]A:1331 |
14 |
1 |
422 |
◊ |
B |
x,y,z |
1_555 |
32 |
6 |
17224 |
175.2 |
-1.4 |
0.308 |
0 |
0 |
0 |
0.115 |
24 |
|
[C8E]A:1335 |
7 |
1 |
297 |
f |
[ACX]A:1325 |
x,y,z |
1_555 |
29 |
1 |
958 |
167.4 |
5.8 |
0.000 |
0 |
0 |
0 |
0.000 |
25 |
|
[C8E]B:1333 |
14 |
1 |
469 |
f |
A |
-x+2,-y,z |
2_755 |
27 |
9 |
17877 |
166.6 |
-0.6 |
0.061 |
0 |
0 |
0 |
0.047 |
26 |
|
[C8E]B:1336 |
7 |
1 |
297 |
f |
[ACX]B:1325 |
x,y,z |
1_555 |
28 |
1 |
963 |
166.5 |
5.5 |
0.000 |
0 |
0 |
0 |
0.000 |
27 |
|
[C8E]B:1342 |
7 |
1 |
296 |
f |
[ACX]B:1326 |
x,y,z |
1_555 |
31 |
1 |
969 |
165.6 |
5.5 |
0.000 |
0 |
0 |
0 |
0.000 |
28 |
|
B |
24 |
9 |
17224 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
15 |
3 |
17877 |
151.1 |
-0.6 |
0.572 |
4 |
0 |
0 |
0.000 |
29 |
|
[C8E]B:1339 |
7 |
1 |
296 |
f |
B |
x,y,z |
1_555 |
26 |
8 |
17224 |
150.9 |
4.5 |
0.000 |
0 |
0 |
0 |
0.000 |
30 |
|
[C8E]B:1338 |
13 |
1 |
397 |
f |
B |
x,y,z |
1_555 |
16 |
5 |
17224 |
149.8 |
-0.8 |
0.626 |
3 |
0 |
0 |
0.173 |
31 |
|
[C8E]A:1329 |
13 |
1 |
581 |
◊ |
B |
-x+2,-y+1,z |
2_765 |
17 |
6 |
17224 |
149.1 |
0.5 |
0.327 |
1 |
0 |
0 |
0.000 |
32 |
|
[C8E]B:1340 |
7 |
1 |
278 |
f |
B |
x,y,z |
1_555 |
24 |
9 |
17224 |
149.0 |
4.2 |
0.090 |
0 |
0 |
0 |
0.000 |
33 |
|
[C8E]B:1333 |
12 |
1 |
469 |
◊ |
B |
x,y,z |
1_555 |
28 |
6 |
17224 |
142.7 |
4.0 |
0.315 |
0 |
0 |
0 |
0.000 |
34 |
|
[C8E]B:1341 |
8 |
1 |
324 |
f |
B |
x,y,z |
1_555 |
21 |
5 |
17224 |
139.5 |
4.9 |
0.689 |
0 |
0 |
0 |
0.000 |
35 |
|
[C8E]B:1334 |
12 |
1 |
425 |
◊ |
B |
x,y,z |
1_555 |
13 |
6 |
17224 |
136.2 |
-1.0 |
0.389 |
0 |
0 |
0 |
0.085 |
36 |
|
[C8E]A:1338 |
11 |
1 |
424 |
◊ |
A |
x,y,z |
1_555 |
15 |
6 |
17877 |
135.8 |
-1.1 |
0.247 |
0 |
0 |
0 |
0.000 |
37 |
|
[C8E]B:1327 |
11 |
1 |
634 |
◊ |
A |
-x+2,-y,z |
2_755 |
14 |
7 |
17877 |
130.7 |
1.0 |
0.163 |
0 |
0 |
0 |
0.000 |
38 |
|
[C8E]B:1329 |
10 |
1 |
408 |
f |
B |
x,y,z |
1_555 |
20 |
8 |
17224 |
129.6 |
2.7 |
0.116 |
0 |
0 |
0 |
0.000 |
39 |
|
[C8E]B:1329 |
11 |
1 |
408 |
◊ |
A |
-x+2,-y,z |
2_755 |
25 |
6 |
17877 |
127.4 |
2.4 |
0.099 |
0 |
0 |
0 |
0.000 |
40 |
|
[C8E]A:1327 |
8 |
1 |
281 |
f |
A |
x,y,z |
1_555 |
21 |
9 |
17877 |
126.0 |
-0.1 |
0.536 |
0 |
0 |
0 |
0.005 |
41 |
|
[C8E]A:1333 |
10 |
1 |
392 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
17877 |
115.2 |
3.0 |
0.124 |
0 |
0 |
0 |
0.000 |
42 |
|
[C8E]B:1335 |
8 |
1 |
297 |
◊ |
A |
x,y,z |
1_555 |
19 |
6 |
17877 |
113.4 |
-1.2 |
0.351 |
0 |
0 |
0 |
0.094 |
43 |
|
[C8E]A:1334 |
9 |
1 |
324 |
f |
A |
x,y,z |
1_555 |
11 |
3 |
17877 |
112.3 |
-1.6 |
0.587 |
2 |
0 |
0 |
0.204 |
44 |
|
[C8E]B:1330 |
6 |
1 |
303 |
f |
B |
x,y,z |
1_555 |
18 |
6 |
17224 |
112.1 |
0.5 |
0.390 |
0 |
0 |
0 |
0.000 |
45 |
|
[C8E]B:1328 |
12 |
1 |
505 |
f |
A |
-x+2,-y,z |
2_755 |
16 |
5 |
17877 |
109.6 |
-0.7 |
0.110 |
0 |
0 |
0 |
0.055 |
46 |
|
[C8E]A:1328 |
9 |
1 |
556 |
◊ |
B |
-x+2,-y,z |
2_755 |
13 |
5 |
17224 |
109.0 |
2.0 |
0.207 |
0 |
0 |
0 |
0.000 |
47 |
|
[C8E]B:1332 |
7 |
1 |
322 |
f |
B |
x,y,z |
1_555 |
15 |
3 |
17224 |
95.6 |
-0.1 |
0.273 |
0 |
0 |
0 |
0.006 |
48 |
|
[C8E]B:1335 |
7 |
1 |
297 |
f |
B |
x,y,z |
1_555 |
12 |
4 |
17224 |
94.6 |
-0.9 |
0.527 |
1 |
0 |
0 |
0.108 |
49 |
|
[C8E]B:1328 |
9 |
1 |
505 |
◊ |
[C8E]B:1327 |
x,y,z |
1_555 |
13 |
1 |
634 |
92.7 |
3.5 |
0.302 |
0 |
0 |
0 |
0.000 |
50 |
|
A |
12 |
2 |
17877 |
◊ |
A |
-x+2,-y+1,z |
2_765 |
12 |
2 |
17877 |
86.7 |
-2.4 |
0.180 |
0 |
0 |
0 |
0.000 |
51 |
|
[C8E]B:1330 |
8 |
1 |
303 |
◊ |
A |
x,y,z |
1_555 |
14 |
5 |
17877 |
84.3 |
0.1 |
0.280 |
0 |
0 |
0 |
0.000 |
52 |
|
B |
11 |
4 |
17224 |
◊ |
[C8E]A:1334 |
x-1/2,-y+1/2,-z |
4_455 |
5 |
1 |
324 |
79.3 |
0.2 |
0.678 |
0 |
0 |
0 |
0.000 |
53 |
|
[C8E]B:1331 |
10 |
1 |
472 |
f |
[C8E]B:1327 |
x,y,z |
1_555 |
8 |
1 |
634 |
78.2 |
4.3 |
0.245 |
0 |
0 |
0 |
0.000 |
54 |
|
[C8E]A:1339 |
5 |
1 |
335 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
17877 |
77.2 |
2.4 |
0.833 |
0 |
0 |
0 |
0.000 |
55 |
|
[C8E]A:1336 |
6 |
1 |
369 |
f |
A |
x,y,z |
1_555 |
13 |
2 |
17877 |
76.2 |
1.9 |
0.011 |
0 |
0 |
0 |
0.000 |
56 |
|
[C8E]A:1333 |
8 |
1 |
392 |
◊ |
[C8E]A:1332 |
x,y,z |
1_555 |
8 |
1 |
390 |
75.4 |
2.2 |
0.089 |
0 |
0 |
0 |
0.000 |
57 |
|
[C8E]B:1332 |
7 |
1 |
322 |
◊ |
[C8E]B:1333 |
x,y,z |
1_555 |
5 |
1 |
469 |
72.5 |
1.9 |
0.235 |
0 |
0 |
0 |
0.000 |
58 |
|
[C8E]A:1336 |
7 |
1 |
369 |
◊ |
B |
-x+2,-y,z |
2_755 |
9 |
3 |
17224 |
72.4 |
1.8 |
0.001 |
0 |
0 |
0 |
0.000 |
59 |
|
[C8E]B:1334 |
6 |
1 |
425 |
f |
A |
x,y,z |
1_555 |
12 |
3 |
17877 |
70.4 |
-2.1 |
0.296 |
0 |
0 |
0 |
0.170 |
60 |
|
B |
9 |
4 |
17224 |
f |
[C8E]A:1333 |
x-1/2,-y+1/2,-z |
4_455 |
5 |
1 |
392 |
67.7 |
1.2 |
0.210 |
0 |
0 |
0 |
0.000 |
61 |
|
[C8E]A:1337 |
7 |
1 |
632 |
f |
[C8E]A:1329 |
x,y,z |
1_555 |
5 |
1 |
581 |
62.4 |
4.1 |
0.612 |
0 |
0 |
0 |
0.000 |
62 |
|
[C8E]B:1332 |
8 |
1 |
322 |
◊ |
A |
-x+2,-y,z |
2_755 |
6 |
2 |
17877 |
61.4 |
-0.5 |
0.217 |
0 |
0 |
0 |
0.000 |
63 |
|
[C8E]B:1342 |
4 |
1 |
296 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
17224 |
60.4 |
1.7 |
0.646 |
0 |
0 |
0 |
0.000 |
64 |
|
[C8E]A:1337 |
6 |
1 |
632 |
◊ |
[C8E]A:1338 |
x,y,z |
1_555 |
5 |
1 |
424 |
59.2 |
-1.4 |
0.240 |
0 |
0 |
0 |
0.000 |
65 |
|
[C8E]A:1327 |
6 |
1 |
281 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
17224 |
58.8 |
-1.2 |
0.322 |
0 |
0 |
0 |
0.101 |
66 |
|
[C8E]B:1341 |
6 |
1 |
324 |
◊ |
[C8E]A:1329 |
-x+2,-y+1,z |
2_765 |
6 |
1 |
581 |
57.0 |
1.1 |
0.516 |
0 |
0 |
0 |
0.000 |
67 |
|
[C8E]A:1336 |
6 |
1 |
369 |
f |
[C8E]A:1328 |
x,y,z |
1_555 |
7 |
1 |
556 |
53.0 |
0.7 |
0.000 |
0 |
0 |
0 |
0.000 |
68 |
|
[C8E]B:1327 |
7 |
1 |
634 |
◊ |
[C8E]A:1328 |
-x+2,-y,z |
2_755 |
7 |
1 |
556 |
52.7 |
-0.4 |
0.268 |
0 |
0 |
0 |
0.000 |
69 |
|
[C8E]B:1334 |
4 |
1 |
425 |
f |
[C8E]A:1327 |
x,y,z |
1_555 |
4 |
1 |
281 |
46.9 |
-1.3 |
0.409 |
0 |
0 |
0 |
0.104 |
70 |
|
A |
6 |
3 |
17877 |
◊ |
A |
-x+2,-y,z |
2_755 |
6 |
3 |
17877 |
46.8 |
0.4 |
0.762 |
0 |
0 |
0 |
0.000 |
71 |
|
[C8E]B:1338 |
5 |
1 |
397 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
7 |
4 |
17877 |
43.6 |
-0.6 |
0.619 |
0 |
0 |
0 |
0.000 |
72 |
|
[C8E]B:1329 |
5 |
1 |
408 |
◊ |
[C8E]A:1336 |
-x+2,-y,z |
2_755 |
6 |
1 |
369 |
42.9 |
2.8 |
0.000 |
0 |
0 |
0 |
0.000 |
73 |
|
[C8E]A:1334 |
5 |
1 |
324 |
f |
[C8E]A:1332 |
x,y,z |
1_555 |
3 |
1 |
390 |
41.2 |
-1.3 |
0.399 |
0 |
0 |
0 |
0.106 |
74 |
|
[C8E]B:1334 |
3 |
1 |
425 |
◊ |
A |
-x+2,-y,z |
2_755 |
7 |
3 |
17877 |
37.6 |
1.3 |
0.700 |
0 |
0 |
0 |
0.000 |
75 |
|
[C8E]B:1334 |
2 |
1 |
425 |
◊ |
[C8E]A:1328 |
-x+2,-y,z |
2_755 |
5 |
1 |
556 |
35.8 |
2.2 |
0.648 |
0 |
0 |
0 |
0.000 |
76 |
|
[C8E]B:1332 |
1 |
1 |
322 |
f |
[C8E]B:1331 |
x,y,z |
1_555 |
4 |
1 |
472 |
34.8 |
0.8 |
0.245 |
0 |
0 |
0 |
0.000 |
77 |
|
[C8E]B:1330 |
2 |
1 |
303 |
f |
[C8E]B:1335 |
x,y,z |
1_555 |
4 |
1 |
297 |
33.1 |
-0.5 |
0.418 |
0 |
0 |
0 |
0.044 |
78 |
|
[C8E]B:1329 |
4 |
1 |
408 |
◊ |
[C8E]A:1328 |
-x+2,-y,z |
2_755 |
6 |
1 |
556 |
32.8 |
0.3 |
0.148 |
0 |
0 |
0 |
0.000 |
79 |
|
[C8E]B:1330 |
3 |
1 |
303 |
◊ |
[C8E]A:1331 |
x,y,z |
1_555 |
2 |
1 |
422 |
30.4 |
2.0 |
0.647 |
0 |
0 |
0 |
0.000 |
80 |
|
[C8E]A:1337 |
6 |
1 |
632 |
f |
[C8E]A:1330 |
x,y,z |
1_555 |
2 |
1 |
556 |
29.5 |
0.6 |
0.370 |
0 |
0 |
0 |
0.000 |
81 |
|
B |
3 |
2 |
17224 |
◊ |
[C8E]A:1332 |
x-1/2,-y+1/2,-z |
4_455 |
4 |
1 |
390 |
29.0 |
-0.5 |
0.397 |
0 |
0 |
0 |
0.000 |
82 |
|
[C8E]B:1337 |
1 |
1 |
676 |
◊ |
[C8E]A:1337 |
-x+2,-y+1,z |
2_765 |
3 |
1 |
632 |
28.6 |
0.8 |
0.449 |
0 |
0 |
0 |
0.000 |
83 |
|
[C8E]B:1329 |
2 |
1 |
408 |
f |
[C8E]B:1327 |
x,y,z |
1_555 |
5 |
1 |
634 |
28.2 |
0.5 |
0.264 |
0 |
0 |
0 |
0.000 |
84 |
|
[C8E]A:1336 |
1 |
1 |
369 |
◊ |
[C8E]B:1327 |
-x+2,-y,z |
2_755 |
5 |
1 |
634 |
25.5 |
0.4 |
0.395 |
0 |
0 |
0 |
0.000 |
85 |
|
[C8E]B:1329 |
1 |
1 |
408 |
◊ |
[C8E]B:1328 |
x,y,z |
1_555 |
4 |
1 |
505 |
25.1 |
1.7 |
0.521 |
0 |
0 |
0 |
0.000 |
86 |
|
[C8E]B:1333 |
3 |
1 |
469 |
◊ |
[C8E]B:1331 |
x,y,z |
1_555 |
1 |
1 |
472 |
21.9 |
0.1 |
0.209 |
0 |
0 |
0 |
0.000 |
87 |
|
[C8E]B:1333 |
3 |
1 |
469 |
◊ |
[C8E]B:1327 |
x,y,z |
1_555 |
3 |
1 |
634 |
18.0 |
0.3 |
0.220 |
0 |
0 |
0 |
0.000 |
88 |
|
[C8E]B:1331 |
1 |
1 |
472 |
◊ |
A |
-x+2,-y,z |
2_755 |
1 |
1 |
17877 |
13.8 |
0.7 |
0.571 |
0 |
0 |
0 |
0.000 |
89 |
|
[C8E]B:1334 |
2 |
1 |
425 |
◊ |
[C8E]B:1327 |
x,y,z |
1_555 |
1 |
1 |
634 |
9.7 |
-0.2 |
0.381 |
0 |
0 |
0 |
0.015 |
90 |
|
[C8E]B:1343 |
2 |
1 |
422 |
f |
[C8E]B:1332 |
x,y,z |
1_555 |
1 |
1 |
322 |
4.7 |
0.2 |
0.309 |
0 |
0 |
0 |
0.000 |
|